Vitas-M small molecule compound
methyl (4Z)-1-(3,4-dimethylphenyl)-4-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168490
SMILES C=CCOc1ccc(cc1OC)/C=C/1\C(=O)N(C(=C1C(=O)OC)C)c1ccc(c(c1)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H27NO5 MW 433.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO5/c1-7-12-32-22-11-9-19(15-23(22)30-5)14-21-24(26(29)31-6)18(4)27(25(21)28)20-10-8-16(2)17(3)13-20/h7-11,13-15H,1,12H2,2-6H3/b21-14-InChIKey
CCXDADPSYBWPMX-STZFKDTASA-NSynonyms
C=CCOc1ccc(cc1OC)C=C1C(=O)N(C(=C1C(=O)OC)C)c1ccc(c(c1)C)C
CC1=C(C=C(C=C1)N2C(=C(C(=CC3=CC(=C(C=C3)OCC=C)OC)C2=O)C(=O)OC)C)C
InChI=1SC26H27NO5c1712322211919(1523(22)305)142124(26(29)316)18(4)27(25(21)28)2010816(2)17(3)1320h7111315H112H226H3b2114
METHYL(4Z)1(34DIMETHYLPHENYL)4((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)1(34DIMETHYLPHENYL)4(3METHOXY4(PROP2EN1YLOXY)BENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL4(4(ALLYLOXY)3METHOXYBENZYLIDENE)1(34DIMETHYLPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03269826
ZINC000002089317
ZINC02089317
ZINC2089317
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